null

SMILES: CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=Cc6c(C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)cnn6-c1ccc(OCCCCCCCCCP(O)(O)=O)cc1

InChI Key: InChIKey=WZBNEBURHZRFPI-AXMSIJNASA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 476594   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
TSC22 domain family protein 3 (Human)	BDBM476594 (US10869929, Compound 32) Show SMILES CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=Cc6c(C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO)cnn6-c1ccc(OCCCCCCCCCP(O)(O)=O)cc1 |r,t:11| Show InChI InChI=1S/C41H59N2O9P/c1-4-12-37-51-36-22-32-31-18-13-28-21-33-27(23-39(28,2)38(31)34(45)24-40(32,3)41(36,52-37)35(46)26-44)25-42-43(33)29-14-16-30(17-15-29)50-19-10-8-6-5-7-9-11-20-53(47,48)49/h14-17,21,25,31-32,34,36-38,44-45H,4-13,18-20,22-24,26H2,1-3H3,(H2,47,48,49)/t31-,32-,34-,36+,37?,38+,39-,40-,41+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	115	n/a	n/a	n/a	n/a	n/a	n/a
MERCK SHARP & DOHME CORP. US Patent					Assay Description HUT78 cells were cultured in IMEM plus 20% heat inactivated FBS and cell density was maintained between 0.1 to 1.2 million/mL. 786-O cells were cultu...				US Patent US10869929 (2020)
					More data for this Ligand-Target Pair